3-[2-(5-acetamido-2-acetyloxy-4-octanoyl-phenyl)ethyl]hexyl ethanoate

Systemtic Name: 3-[2-(5-acetamido-2-acetyloxy-4-octanoyl-phenyl)ethyl]hexyl ethanoate Openeye Name: 3-[2-(5-acetamido-2-acetoxy-4-octanoyl-phenyl)ethyl]hexyl acetate CAS Name: acetic acid 3-[2-[5-acetamido-2-acetyloxy-4-(1-oxooctyl)phenyl]ethyl]hexyl ester IUPAC Name: 3-[2-(5-acetamido-2-acetyloxy-4-octanoylphenyl)ethyl]hexyl acetate Traditional Name: acetic acid 3-[2-(5-acetamido-2-acetoxy-4-caprylyl-phenyl)ethyl]hexyl ester Formula: C28H43NO6 MolecularWeight: 489.64412

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)C1=CC(=C(C=C1NC(=O)C)CCC(CCC)CCOC(=O)C)OC(=O)C

Isomeric SMILES

CCCCCCCC(=O)C1=CC(=C(C=C1NC(=O)C)CCC(CCC)CCOC(=O)C)OC(=O)C

InChI

InChI=1S/C28H43NO6/c1-6-8-9-10-11-13-27(33)25-19-28(35-22(5)32)24(18-26(25)29-20(3)30)15-14-23(12-7-2)16-17-34-21(4)31/h18-19,23H,6-17H2,1-5H3,(H,29,30)